SCHEMBL10258482

SCHEMBL10258482

NC(=O)[C@H](CCNC(CO)c1ccccc1)c1ccc(Cl)cc1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 3/20 0.44
EPHX1 P07099 1/20 0.42
KDM4E B2RXH2 1/20 0.42
GAA P10253 1/20 0.42
THRB P10828 1/20 0.41
PHGDH O43175 1/20 0.41
CNR2 P34972 2/20 0.40
CASR P41180 1/20 0.40
UTS2R Q9UKP6 7/20 0.40
EPHX2 P34913 2/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
RIPK1 Q13546 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL12188442 0.87 CNR1 (0.44) CNR1KDM4EGAAPHGDHCNR2
SCHEMBL680837 0.85 CNR1 (0.42) CNR1KDM4EGAAPHGDHUTS2R
SCHEMBL20282975 0.78 GPR88 (0.43) CNR1PHGDHUTS2R
SCHEMBL680232 0.75 TAS1R3 (0.43) CNR1KDM4EGAACNR2CASR
SCHEMBL9363415 0.72 EPHX1 (0.49) CNR1EPHX1THRBCASRMEN1
SCHEMBL2738729 0.72 P2RX7 (0.41)
SCHEMBL28419253 0.71 CYP2C9 (0.49) EPHX1THRBMEN1KMT2A
SCHEMBL21979535 0.71 KDM4E (0.47) CNR1KDM4EGAAPHGDHCNR2
SCHEMBL21979517 0.71 KDM4E (0.47) CNR1KDM4EGAAPHGDHCNR2
SCHEMBL4826506 0.71 GABBR2 (0.46) EPHX1THRBMEN1KMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2402325-A2 Hydroxylated and methoxylated cyclopenta[d]pyrimidines as AKT protein kinase inhibitors Array Biopharma, Inc. (US) 2012-01-04 EP disclosed
EP-2399909-A1 Hydroxylated and methoxylated cyclopenta[d]pyrimidines as akt protein kinase inhibitors Array Biopharma, Inc. (US) 2011-12-28 EP disclosed